#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hbh h VAL 49 N 0.00 1.14 -0.03 0.44 2.07 -1.88 -2.12 116.25 115.86 3hbh h VAL 49 Ca 0.00 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.17 3hbh h VAL 49 Cb 0.00 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.78 3hbh h VAL 49 CO 0.00 0.19 0.05 1.23 0.02 0.00 0.00 177.57 179.06 3hbh h GLY 50 N 1.03 0.00 1.79 2.17 0.00 -1.97 0.35 103.07 106.45 3hbh h GLY 50 Ca 0.33 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.53 3hbh h GLY 50 CO -0.10 0.00 -0.56 -1.33 0.00 0.00 0.00 176.54 174.55 3hbh h GLY 51 N 0.00 0.24 0.41 4.60 0.00 -1.84 -3.33 103.07 103.15 3hbh h GLY 51 Ca 0.01 -0.28 -0.32 0.00 0.00 0.00 0.00 47.33 46.74 3hbh h GLY 51 CO -0.00 0.25 -1.74 -2.22 0.00 0.00 0.00 176.54 172.84 3hbh h ILE 52 N 0.17 0.73 -3.51 2.60 2.04 -0.59 -3.45 117.51 115.50 3hbh h ILE 52 Ca -0.00 -2.29 -0.71 0.00 1.00 0.00 0.00 64.86 62.86 3hbh h ILE 52 Cb 1.04 2.41 -0.27 0.00 -0.74 0.00 0.00 36.82 39.26 3hbh h ILE 52 CO 0.09 0.69 -0.50 -0.63 0.00 0.00 0.00 178.15 177.80 3hbh s ILE 53 N -2.49 4.26 0.78 -0.67 -1.09 0.89 -5.07 121.20 117.82 3hbh s ILE 53 Ca -0.24 -1.24 -0.09 0.00 -2.23 0.00 0.00 60.65 56.84 3hbh s ILE 53 Cb 0.06 -3.53 0.10 0.00 -1.58 0.00 0.00 42.46 37.51 3hbh s ILE 53 CO 0.71 -0.40 1.12 -0.94 -1.23 0.00 0.00 174.94 174.19 3hbh s SER 54 N 1.89 4.37 0.19 3.58 1.04 -1.25 -4.25 113.70 119.28 3hbh s SER 54 Ca 0.02 0.44 -0.11 0.00 0.48 0.00 0.00 55.95 56.78 3hbh s SER 54 Cb -0.22 -0.91 0.21 0.00 0.10 0.00 0.00 66.02 65.20 3hbh s SER 54 CO 0.03 -1.92 1.77 -0.61 0.98 0.00 0.00 173.24 173.49 3hbh h GLN 55 N -0.92 0.47 -0.23 4.02 5.75 -1.98 -1.59 115.11 120.62 3hbh h GLN 55 Ca -0.44 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.01 3hbh h GLN 55 Cb 1.30 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.74 3hbh h GLN 55 CO 0.56 0.31 0.07 1.03 -2.65 0.00 0.00 178.83 178.15 3hbh h SER 56 N 0.48 0.34 -0.78 -0.69 0.87 -1.99 -0.66 113.55 111.12 3hbh h SER 56 Ca 0.27 -0.21 0.05 0.00 -1.23 0.00 0.00 61.79 60.67 3hbh h SER 56 Cb 0.24 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.06 3hbh h SER 56 CO -0.22 0.45 0.48 0.15 -0.53 0.00 0.00 176.83 177.16 3hbh h PHE 57 N 0.20 0.89 -0.58 2.24 3.57 -1.87 -1.12 116.94 120.28 3hbh h PHE 57 Ca 0.07 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 3hbh h PHE 57 Cb 0.24 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 3hbh h PHE 57 CO 0.00 0.47 0.13 0.35 -2.23 0.00 0.00 178.31 177.04 3hbh h PHE 58 N 0.90 0.99 -0.09 0.41 3.57 -1.05 -2.66 116.94 119.01 3hbh h PHE 58 Ca 0.33 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 3hbh h PHE 58 Cb 0.11 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 3hbh h PHE 58 CO -0.04 0.85 -0.23 -0.91 -2.23 0.00 0.00 178.31 175.74 3hbh h ASN 59 N 0.84 0.15 -0.10 0.41 2.35 -0.88 -0.60 115.58 117.74 3hbh h ASN 59 Ca 0.18 -0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.91 3hbh h ASN 59 Cb 0.37 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 3hbh h ASN 59 CO 0.00 0.40 -0.03 1.23 -1.65 0.00 0.00 177.43 177.39 3hbh h GLY 60 N 0.88 0.07 0.93 2.83 0.00 -0.87 0.49 103.07 107.41 3hbh h GLY 60 Ca 0.02 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 3hbh h GLY 60 CO 0.03 -0.04 0.12 1.41 0.00 0.00 0.00 176.54 178.06 3hbh h LEU 61 N -0.00 0.30 -0.72 3.11 3.38 -1.19 -3.26 115.31 116.93 3hbh h LEU 61 Ca 0.05 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 3hbh h LEU 61 Cb 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3hbh h LEU 61 CO -0.11 0.32 -0.61 0.00 0.09 0.00 0.00 178.44 178.13 3hbh h ALA 62 N 0.99 0.93 0.00 1.53 0.00 -1.07 -3.33 119.26 118.31 3hbh h ALA 62 Ca 0.08 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3hbh h ALA 62 Cb 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3hbh h ALA 62 CO -0.01 0.76 0.00 0.78 0.00 0.00 0.00 179.25 180.78 3hbh h GLY 63 N 2.00 0.00 2.00 0.00 0.00 -0.93 -3.02 103.07 103.11 3hbh h GLY 63 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3hbh h GLY 63 CO 0.08 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.29 3hbh h GLY 64 N 3.78 0.00 -3.69 4.60 0.00 -1.69 -3.45 103.07 102.62 3hbh h GLY 64 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 3hbh h GLY 64 CO 0.00 0.00 0.66 0.00 0.00 0.00 0.00 176.54 177.20 3hbh s ALA 65 N -3.44 3.41 0.50 3.60 0.00 -1.14 -4.98 121.76 119.71 3hbh s ALA 65 Ca 0.04 1.32 -0.23 0.00 0.00 0.00 0.00 51.96 53.09 3hbh s ALA 65 Cb 0.08 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.62 3hbh s ALA 65 CO 0.58 -0.82 1.34 0.00 0.00 0.00 0.00 175.76 176.86 3hbh s ALA 66 N -1.19 2.96 0.46 0.00 0.00 -1.26 -4.90 121.76 117.84 3hbh s ALA 66 Ca 0.53 1.30 0.17 0.00 0.00 0.00 0.00 51.96 53.96 3hbh s ALA 66 Cb -0.41 -3.54 1.12 0.00 0.00 0.00 0.00 23.12 20.29 3hbh s ALA 66 CO 0.54 -1.20 2.03 0.66 0.00 0.00 0.00 175.76 177.78 3hbh h SER 67 N 1.81 0.00 0.19 0.00 4.64 -1.95 0.10 113.55 118.34 3hbh h SER 67 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3hbh h SER 67 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3hbh h SER 67 CO 0.59 0.15 0.00 -1.54 -0.87 0.00 0.00 176.83 175.15 3hbh n SER 68 N -4.26 0.00 -4.74 4.97 3.41 -1.26 -4.83 113.62 106.92 3hbh n SER 68 Ca -0.02 -0.15 -0.41 0.00 -0.26 0.00 0.00 58.87 58.02 3hbh n SER 68 Cb 0.22 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 3hbh n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hbh h GLU 70 N 5.49 0.00 0.00 0.00 4.11 -1.84 -2.57 114.58 119.77 3hbh h GLU 70 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 3hbh h GLU 70 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3hbh h GLU 70 CO 0.79 0.26 0.00 0.78 0.07 0.00 0.00 179.01 180.91 3hbh h GLY 71 N 0.80 0.00 -6.88 1.06 0.00 -1.18 -3.40 103.07 93.48 3hbh h GLY 71 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 3hbh h GLY 71 CO 0.03 0.00 1.03 1.25 0.00 0.00 0.00 176.54 178.85 3hbh s LYS 72 N -3.71 3.53 0.00 4.80 2.47 -0.97 -0.95 119.74 124.90 3hbh s LYS 72 Ca -0.01 0.59 0.00 0.00 -1.56 0.00 0.00 55.97 55.00 3hbh s LYS 72 Cb 0.10 -4.02 0.00 0.00 -1.46 0.00 0.00 37.83 32.45 3hbh s LYS 72 CO 0.41 -1.64 0.00 0.41 0.16 0.00 0.00 175.35 174.69 3hbh n GLY 73 N 5.07 0.83 0.13 5.54 0.00 -1.26 -4.89 105.19 110.61 3hbh n GLY 73 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 3hbh n GLY 73 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3hbh n PHE 74 N -2.00 0.46 -2.68 1.61 7.35 -0.20 -4.78 117.46 117.21 3hbh n PHE 74 Ca 0.00 0.18 -0.43 0.00 -0.76 0.00 0.00 57.45 56.44 3hbh n PHE 74 Cb 0.00 -1.05 -0.03 0.00 0.35 0.00 0.00 39.48 38.75 3hbh n PHE 74 CO 0.00 0.00 0.00 0.71 -0.76 0.00 0.00 176.76 176.71 3hbh s TYR 75 N -2.46 2.80 0.20 -5.13 2.02 -0.13 -4.72 117.35 109.93 3hbh s TYR 75 Ca -0.34 0.48 0.08 0.00 -0.37 0.00 0.00 57.07 56.93 3hbh s TYR 75 Cb 0.11 -4.29 -0.05 0.00 -0.40 0.00 0.00 41.96 37.33 3hbh s TYR 75 CO 0.55 -1.30 -0.16 0.95 -1.57 0.00 0.00 175.55 174.02 3hbh s THR 76 N 4.32 1.81 0.25 -0.71 -4.23 -1.26 -4.94 115.64 110.89 3hbh s THR 76 Ca 0.42 -2.16 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 3hbh s THR 76 Cb -0.08 -2.01 0.11 0.00 1.34 0.00 0.00 72.50 71.86 3hbh s THR 76 CO 0.28 -0.51 1.75 0.22 -0.54 0.00 0.00 174.62 175.82 3hbh h TYR 77 N 2.70 0.88 -0.30 3.99 3.20 -1.95 -2.28 116.97 123.21 3hbh h TYR 77 Ca -0.39 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 61.37 3hbh h TYR 77 Cb 1.22 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 3hbh h TYR 77 CO 0.72 0.80 0.17 -0.91 -1.64 0.00 0.00 178.16 177.30 3hbh h ASN 78 N 0.77 0.28 -0.03 -2.11 2.35 -1.99 0.81 115.58 115.66 3hbh h ASN 78 Ca 0.15 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3hbh h ASN 78 Cb 0.44 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.76 3hbh h ASN 78 CO 0.02 0.21 0.01 0.00 -1.65 0.00 0.00 177.43 176.01 3hbh h ALA 79 N 1.13 0.04 -0.34 -0.83 0.00 -1.87 -2.12 119.26 115.28 3hbh h ALA 79 Ca 0.12 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.97 3hbh h ALA 79 Cb 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 3hbh h ALA 79 CO -0.06 -0.33 -0.08 0.35 0.00 0.00 0.00 179.25 179.13 3hbh h PHE 80 N -0.17 -0.17 -0.26 0.00 3.57 -1.22 -1.44 116.94 117.24 3hbh h PHE 80 Ca 0.01 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 3hbh h PHE 80 Cb 0.24 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 3hbh h PHE 80 CO 0.01 -0.14 0.10 0.82 -2.23 0.00 0.00 178.31 176.87 3hbh h ILE 81 N 0.00 1.17 -0.22 1.41 1.08 -0.83 0.18 117.51 120.30 3hbh h ILE 81 Ca 0.16 -0.53 0.06 0.00 -0.39 0.00 0.00 64.86 64.16 3hbh h ILE 81 Cb 0.25 1.03 -0.06 0.00 -3.07 0.00 0.00 36.82 34.97 3hbh h ILE 81 CO -0.35 0.18 -0.20 0.00 -0.69 0.00 0.00 178.15 177.09 3hbh h ALA 82 N 0.95 -0.07 -0.32 1.87 0.00 -1.36 -0.92 119.26 119.41 3hbh h ALA 82 Ca 0.09 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3hbh h ALA 82 Cb 0.18 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3hbh h ALA 82 CO -0.01 -0.62 0.21 0.00 0.00 0.00 0.00 179.25 178.82 3hbh h ALA 83 N 0.88 0.41 -0.62 0.00 0.00 -1.06 -2.89 119.26 115.98 3hbh h ALA 83 Ca 0.13 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.09 3hbh h ALA 83 Cb 0.40 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 3hbh h ALA 83 CO -0.34 -0.14 0.31 0.00 0.00 0.00 0.00 179.25 179.08 3hbh h ALA 84 N 1.13 0.83 0.00 0.00 0.00 -0.62 -2.40 119.26 118.20 3hbh h ALA 84 Ca 0.12 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3hbh h ALA 84 Cb -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3hbh h ALA 84 CO -0.04 -0.05 0.00 -0.91 0.00 0.00 0.00 179.25 178.26 3hbh h ASN 85 N 0.57 0.00 0.70 0.00 -0.26 -1.04 -3.05 115.58 112.50 3hbh h ASN 85 Ca 0.29 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.03 3hbh h ASN 85 Cb 0.24 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 3hbh h ASN 85 CO -0.21 0.00 -0.20 0.00 -1.06 0.00 0.00 177.43 175.95 3hbh n ALA 86 N -1.99 2.86 -3.93 -0.83 0.00 -0.90 -4.52 120.51 111.20 3hbh n ALA 86 Ca 0.01 -0.22 -0.30 0.00 0.00 0.00 0.00 53.44 52.92 3hbh n ALA 86 Cb 0.26 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.25 3hbh n ALA 86 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3hbh s TYR 87 N -2.90 3.17 0.11 0.00 1.51 -1.15 -5.10 117.35 112.98 3hbh s TYR 87 Ca 0.16 -2.82 -0.36 0.00 -1.01 0.00 0.00 57.07 53.04 3hbh s TYR 87 Cb 0.19 -2.63 -0.16 0.00 -0.11 0.00 0.00 41.96 39.24 3hbh s TYR 87 CO 0.58 -0.87 1.36 0.45 -1.11 0.00 0.00 175.55 175.96 3hbh n SER 88 N 3.99 1.89 0.00 2.29 2.88 -1.26 -2.18 113.62 121.23 3hbh n SER 88 Ca 0.04 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 3hbh n SER 88 Cb 0.39 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.61 3hbh n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hbh n GLY 89 N 2.60 2.40 3.62 0.46 0.00 -1.26 -5.02 105.19 107.99 3hbh n GLY 89 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3hbh n GLY 89 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hbh s PHE 90 N -2.46 2.33 -1.28 1.61 5.36 -0.92 -2.72 117.98 119.90 3hbh s PHE 90 Ca 0.00 0.69 0.00 0.00 -0.96 0.00 0.00 56.93 56.66 3hbh s PHE 90 Cb 0.00 -4.04 0.00 0.00 -0.34 0.00 0.00 43.02 38.64 3hbh s PHE 90 CO 0.00 -2.33 0.00 0.41 -1.46 0.00 0.00 175.22 171.84 3hbh n GLY 91 N 4.70 1.15 0.02 13.12 0.00 -1.26 -4.80 105.19 118.12 3hbh n GLY 91 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.21 3hbh n GLY 91 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hbh n THR 92 N -2.18 0.98 -3.65 2.61 -2.24 -1.10 -4.70 114.28 104.00 3hbh n THR 92 Ca -0.12 -1.03 -0.36 0.00 -2.27 0.00 0.00 64.05 60.27 3hbh n THR 92 Cb 0.59 0.47 -0.09 0.00 -2.10 0.00 0.00 70.33 69.20 3hbh n THR 92 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3hbh s THR 93 N -1.10 5.36 0.00 4.28 2.01 -1.14 -4.90 115.64 120.15 3hbh s THR 93 Ca 0.04 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.30 3hbh s THR 93 Cb 0.03 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 69.03 3hbh s THR 93 CO 0.00 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 174.92 3hbh n GLY 94 N 3.89 -1.79 3.66 4.40 0.00 -1.26 -3.95 105.19 110.15 3hbh n GLY 94 Ca -0.15 -1.69 -0.29 0.00 0.00 0.00 0.00 46.02 43.89 3hbh n GLY 94 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hbh s SER 95 N -4.00 2.12 0.20 1.61 1.04 -1.26 -4.74 113.70 108.66 3hbh s SER 95 Ca 0.00 0.95 -0.10 0.00 0.48 0.00 0.00 55.95 57.28 3hbh s SER 95 Cb 0.00 -1.46 0.22 0.00 0.10 0.00 0.00 66.02 64.88 3hbh s SER 95 CO 0.00 -3.42 1.79 0.78 0.98 0.00 0.00 173.24 173.38 3hbh h ASN 96 N -2.09 0.47 -0.24 7.02 2.35 -1.99 -1.41 115.58 119.68 3hbh h ASN 96 Ca -0.51 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.27 3hbh h ASN 96 Cb 1.32 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.62 3hbh h ASN 96 CO 0.50 0.30 0.15 0.44 -1.65 0.00 0.00 177.43 177.18 3hbh h ASP 97 N 0.61 0.30 0.04 5.81 3.32 -1.98 -1.30 116.42 123.22 3hbh h ASP 97 Ca 0.28 -0.01 -0.23 0.00 0.02 0.00 0.00 57.03 57.09 3hbh h ASP 97 Cb 0.19 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 39.68 3hbh h ASP 97 CO -0.19 0.24 -0.87 0.58 -1.72 0.00 0.00 179.24 177.28 3hbh h VAL 98 N 0.35 1.31 -0.42 -1.35 2.07 -1.72 -1.44 116.25 115.06 3hbh h VAL 98 Ca 0.09 -2.15 -0.10 0.00 0.82 0.00 0.00 66.70 65.36 3hbh h VAL 98 Cb -0.01 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 3hbh h VAL 98 CO -0.02 0.67 -0.14 0.11 0.02 0.00 0.00 177.57 178.21 3hbh h LYS 99 N 0.41 0.83 -0.54 1.57 1.57 -0.96 -0.87 116.57 118.57 3hbh h LYS 99 Ca -0.07 -0.34 -0.09 0.00 -1.87 0.00 0.00 60.65 58.28 3hbh h LYS 99 Cb 1.50 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.75 3hbh h LYS 99 CO 0.17 0.97 0.01 0.87 -0.57 0.00 0.00 179.45 180.89 3hbh h LYS 100 N 0.65 0.96 -0.11 3.15 1.57 -1.23 -1.72 116.57 119.84 3hbh h LYS 100 Ca 0.10 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.47 3hbh h LYS 100 Cb 0.69 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 3hbh h LYS 100 CO 0.05 0.97 -0.41 0.00 -0.57 0.00 0.00 179.45 179.49 3hbh h ARG 101 N 0.84 0.25 -0.19 3.15 3.08 -1.11 -0.38 114.38 120.01 3hbh h ARG 101 Ca 0.16 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 3hbh h ARG 101 Cb 0.53 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 3hbh h ARG 101 CO 0.03 0.62 -0.25 1.49 -1.07 0.00 0.00 179.97 180.79 3hbh h GLU 102 N 0.21 0.51 -0.61 0.04 4.81 -0.93 -0.93 114.58 117.67 3hbh h GLU 102 Ca 0.02 -0.29 -0.00 0.00 -0.13 0.00 0.00 59.36 58.96 3hbh h GLU 102 Cb 0.81 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.18 3hbh h GLU 102 CO 0.06 0.88 0.37 -0.07 -0.73 0.00 0.00 179.01 179.53 3hbh h LEU 103 N 0.18 0.74 -0.46 1.64 3.38 -1.25 0.33 115.31 119.86 3hbh h LEU 103 Ca 0.02 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3hbh h LEU 103 Cb 0.81 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3hbh h LEU 103 CO 0.06 0.58 0.28 0.00 0.09 0.00 0.00 178.44 179.45 3hbh h ALA 104 N 1.19 0.59 -0.35 1.53 0.00 -1.05 -0.66 119.26 120.50 3hbh h ALA 104 Ca 0.22 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hbh h ALA 104 Cb -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3hbh h ALA 104 CO -0.04 0.08 0.23 0.00 0.00 0.00 0.00 179.25 179.52 3hbh h ALA 105 N 1.13 0.44 0.28 0.00 0.00 -0.96 0.90 119.26 121.04 3hbh h ALA 105 Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hbh h ALA 105 Cb -0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 3hbh h ALA 105 CO -0.03 -0.10 -0.48 0.35 0.00 0.00 0.00 179.25 178.99 3hbh h PHE 106 N 0.46 -1.34 -0.50 0.00 3.57 -0.75 -2.35 116.94 116.04 3hbh h PHE 106 Ca 0.13 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 3hbh h PHE 106 Cb -0.04 0.55 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 3hbh h PHE 106 CO -0.06 -0.60 0.24 0.74 -2.23 0.00 0.00 178.31 176.41 3hbh h PHE 107 N -0.82 0.68 -0.19 0.41 -1.00 -1.00 -1.93 116.94 113.10 3hbh h PHE 107 Ca -0.02 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.73 3hbh h PHE 107 Cb 0.77 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 40.11 3hbh h PHE 107 CO -0.34 0.50 0.06 0.00 -1.61 0.00 0.00 178.31 176.93 3hbh h ALA 108 N 1.57 0.25 -0.23 2.45 0.00 -0.78 0.48 119.26 123.00 3hbh h ALA 108 Ca 0.17 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3hbh h ALA 108 Cb 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hbh h ALA 108 CO -0.02 -0.14 0.06 -0.91 0.00 0.00 0.00 179.25 178.23 3hbh h ASN 109 N 0.14 0.04 -0.31 0.00 2.35 -1.12 -0.92 115.58 115.76 3hbh h ASN 109 Ca 0.06 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.87 3hbh h ASN 109 Cb 0.21 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 3hbh h ASN 109 CO -0.00 0.05 0.11 0.58 -1.65 0.00 0.00 177.43 176.53 3hbh h VAL 110 N 0.15 0.93 -0.64 2.81 2.07 -1.28 -1.82 116.25 118.47 3hbh h VAL 110 Ca 0.10 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 3hbh h VAL 110 Cb 0.09 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3hbh h VAL 110 CO -0.12 0.05 0.35 0.24 0.02 0.00 0.00 177.57 178.10 3hbh h MET 111 N 0.26 0.89 -0.07 1.57 2.86 -0.79 -0.77 114.93 118.88 3hbh h MET 111 Ca 0.14 -0.11 0.03 0.00 -2.06 0.00 0.00 59.70 57.70 3hbh h MET 111 Cb 0.10 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.55 3hbh h MET 111 CO -0.13 0.67 -0.11 1.25 1.06 0.00 0.00 176.91 179.65 3hbh h HIS 112 N 0.87 -0.28 0.00 -0.22 6.17 -0.95 0.52 115.15 121.26 3hbh h HIS 112 Ca 0.22 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.32 3hbh h HIS 112 Cb 0.04 0.14 0.00 0.00 2.52 0.00 0.00 27.41 30.11 3hbh h HIS 112 CO -0.01 -0.17 0.00 0.93 0.71 0.00 0.00 177.93 179.39 3hbh h GLU 113 N -0.16 0.00 -0.28 5.26 5.08 -0.83 -3.17 114.58 120.49 3hbh h GLU 113 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3hbh h GLU 113 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3hbh h GLU 113 CO -0.16 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.10 3hbh n THR 114 N -2.46 0.56 -3.43 1.13 -2.24 -0.34 -4.87 114.28 102.62 3hbh n THR 114 Ca 0.04 -0.78 -0.23 0.00 -2.27 0.00 0.00 64.05 60.82 3hbh n THR 114 Cb 0.41 0.86 0.07 0.00 -2.10 0.00 0.00 70.33 69.57 3hbh n THR 114 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hbh n GLY 115 N 0.89 -0.48 1.07 3.38 0.00 -0.91 -0.90 105.19 108.25 3hbh n GLY 115 Ca 0.13 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.34 3hbh n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbh n GLY 116 N -1.86 0.93 3.28 -0.02 0.00 0.12 -3.98 105.19 103.67 3hbh n GLY 116 Ca -0.02 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.29 3hbh n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hbh n LEU 117 N -0.39 -3.05 -0.10 0.99 4.77 -1.23 -4.22 117.00 113.76 3hbh n LEU 117 Ca 0.00 -0.41 -0.20 0.00 -0.03 0.00 0.00 56.01 55.37 3hbh n LEU 117 Cb 0.37 -2.91 -0.12 0.00 -2.33 0.00 0.00 43.42 38.42 3hbh n LEU 117 CO 0.00 0.46 -1.23 0.00 -1.33 0.00 0.00 177.39 175.29 3hbh s TYR 119 N -2.52 3.05 -0.18 0.00 1.51 -0.07 -0.79 117.35 118.34 3hbh s TYR 119 Ca -0.32 -0.10 -0.11 0.00 -1.01 0.00 0.00 57.07 55.52 3hbh s TYR 119 Cb 0.09 -1.87 -0.21 0.00 -0.11 0.00 0.00 41.96 39.85 3hbh s TYR 119 CO 0.63 0.17 0.17 -0.89 -1.11 0.00 0.00 175.55 174.52 3hbh n ILE 120 N 2.94 1.65 -4.31 2.71 5.41 -1.26 -4.72 119.36 121.77 3hbh n ILE 120 Ca -0.18 -0.43 -0.35 0.00 1.00 0.00 0.00 62.75 62.80 3hbh n ILE 120 Cb 0.53 -1.80 -0.10 0.00 -0.71 0.00 0.00 39.64 37.55 3hbh n ILE 120 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 3hbh s ASN 121 N -6.97 5.22 0.19 4.38 0.01 -1.26 -1.56 114.94 114.96 3hbh s ASN 121 Ca -0.28 0.08 -0.31 0.00 -0.71 0.00 0.00 52.86 51.65 3hbh s ASN 121 Cb 0.07 -1.63 -0.16 0.00 0.41 0.00 0.00 41.25 39.94 3hbh s ASN 121 CO 0.67 0.30 0.86 1.21 -1.51 0.00 0.00 177.10 178.63 3hbh n GLU 122 N 2.67 0.63 -2.82 -0.60 2.13 0.11 -4.93 120.64 117.83 3hbh n GLU 122 Ca -0.18 0.22 -0.40 0.00 0.66 0.00 0.00 57.16 57.46 3hbh n GLU 122 Cb 0.53 -1.49 -0.05 0.00 0.27 0.00 0.00 31.44 30.70 3hbh n GLU 122 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3hbh s LYS 123 N -0.87 4.66 -0.81 5.31 1.02 -1.26 -4.30 119.74 123.49 3hbh s LYS 123 Ca 0.68 1.34 -0.15 0.00 0.02 0.00 0.00 55.97 57.86 3hbh s LYS 123 Cb -0.89 -3.35 0.02 0.00 -0.52 0.00 0.00 37.83 33.09 3hbh s LYS 123 CO 0.56 0.31 0.50 0.09 -0.92 0.00 0.00 175.35 175.90 3hbh n ASN 124 N 2.48 -3.48 -4.72 2.83 3.02 -1.26 -4.73 115.26 109.40 3hbh n ASN 124 Ca -0.00 -0.91 -0.42 0.00 -0.03 0.00 0.00 54.58 53.21 3hbh n ASN 124 Cb 0.49 -1.25 -0.02 0.00 -0.61 0.00 0.00 39.78 38.39 3hbh n ASN 124 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3hbh n PRO 125 N -3.24 2.64 0.02 3.52 -0.04 -1.26 -4.86 135.00 131.78 3hbh n PRO 125 Ca -0.17 0.95 0.13 0.00 -0.04 0.00 0.00 63.50 64.37 3hbh n PRO 125 Cb 0.49 -2.75 0.55 0.00 -0.04 0.00 0.00 33.50 31.76 3hbh n PRO 125 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3hbh n PRO 126 N 3.01 0.04 -4.01 0.54 -0.04 -1.26 -4.92 135.00 128.35 3hbh n PRO 126 Ca 0.13 0.07 -0.10 0.00 -0.04 0.00 0.00 63.50 63.56 3hbh n PRO 126 Cb 0.35 -1.55 -0.05 0.00 -0.04 0.00 0.00 33.50 32.21 3hbh n PRO 126 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3hbh s ILE 127 N -3.02 0.00 -1.23 0.52 -4.36 -1.26 -5.06 121.20 106.79 3hbh s ILE 127 Ca 0.12 -1.44 0.27 0.00 -0.26 0.00 0.00 60.65 59.34 3hbh s ILE 127 Cb 0.17 -2.27 0.19 0.00 1.25 0.00 0.00 42.46 41.79 3hbh s ILE 127 CO 0.50 0.00 1.65 -0.46 0.24 0.00 0.00 174.94 176.87 3hbh n ASN 128 N -0.48 0.44 -3.62 4.36 0.23 -1.26 -4.74 115.26 110.19 3hbh n ASN 128 Ca -0.01 -0.22 -0.22 0.00 -0.53 0.00 0.00 54.58 53.59 3hbh n ASN 128 Cb 0.62 -0.01 0.06 0.00 -2.08 0.00 0.00 39.78 38.37 3hbh n ASN 128 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 3hbh n TYR 129 N -1.28 -2.29 -3.62 -2.53 4.02 -1.26 0.09 117.16 110.29 3hbh n TYR 129 Ca 0.09 0.92 -0.40 0.00 -0.01 0.00 0.00 57.90 58.50 3hbh n TYR 129 Cb 0.33 -4.70 -0.11 0.00 -0.02 0.00 0.00 39.34 34.83 3hbh n TYR 129 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3hbh s GLN 131 N 1.55 3.64 0.05 0.00 0.74 -1.26 -5.03 119.66 119.35 3hbh s GLN 131 Ca 0.02 -0.49 -0.35 0.00 0.05 0.00 0.00 55.36 54.59 3hbh s GLN 131 Cb -0.19 -3.33 -0.14 0.00 1.10 0.00 0.00 33.01 30.46 3hbh s GLN 131 CO 0.06 -0.20 1.62 0.45 -0.55 0.00 0.00 175.29 176.68 3hbh n SER 132 N 4.92 2.86 -3.70 6.67 2.88 -1.26 -4.76 113.62 121.24 3hbh n SER 132 Ca -0.16 1.06 -0.14 0.00 -1.33 0.00 0.00 58.87 58.30 3hbh n SER 132 Cb 0.51 -1.35 -0.09 0.00 -0.75 0.00 0.00 64.21 62.54 3hbh n SER 132 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3hbh s SER 133 N 1.83 -0.50 0.28 -3.46 0.15 -1.26 -5.03 113.70 105.71 3hbh s SER 133 Ca 0.85 0.91 0.19 0.00 0.70 0.00 0.00 55.95 58.59 3hbh s SER 133 Cb -0.76 0.93 0.11 0.00 -1.71 0.00 0.00 66.02 64.58 3hbh s SER 133 CO 0.45 -0.22 1.35 0.77 1.20 0.00 0.00 173.24 176.78 3hbh h SER 134 N 5.07 0.00 0.28 5.45 4.64 -2.00 -3.27 113.55 123.74 3hbh h SER 134 Ca -0.28 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.71 3hbh h SER 134 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 3hbh h SER 134 CO 0.22 0.30 -1.77 0.74 -0.87 0.00 0.00 176.83 175.45 3hbh h THR 135 N 0.00 0.87 -2.07 2.95 2.02 -1.99 -3.41 112.91 111.28 3hbh h THR 135 Ca -0.03 -2.56 -0.57 0.00 0.77 0.00 0.00 66.41 64.03 3hbh h THR 135 Cb 1.25 2.63 -0.40 0.00 -1.74 0.00 0.00 68.15 69.88 3hbh h THR 135 CO 0.03 0.81 -0.94 0.79 0.37 0.00 0.00 175.52 176.58 3hbh n TRP 136 N -3.44 1.06 -2.05 3.16 7.02 -1.26 -5.11 117.44 116.83 3hbh n TRP 136 Ca -0.24 -3.78 -0.41 0.00 -1.02 0.00 0.00 57.50 52.06 3hbh n TRP 136 Cb 1.05 -0.42 -0.02 0.00 -2.42 0.00 0.00 31.31 29.50 3hbh n TRP 136 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 3hbh s PRO 137 N -1.77 4.30 0.45 -0.99 0.04 -1.23 -4.57 135.00 131.23 3hbh s PRO 137 Ca 0.37 2.29 -0.24 0.00 0.04 0.00 0.00 61.00 63.47 3hbh s PRO 137 Cb 0.18 -3.05 -0.08 0.00 0.04 0.00 0.00 34.50 31.60 3hbh s PRO 137 CO -0.08 -0.27 1.25 0.00 0.04 0.00 0.00 177.00 177.94 3hbh s THR 139 N -1.39 5.15 0.24 0.00 2.01 -1.26 -5.03 115.64 115.37 3hbh s THR 139 Ca 0.62 0.82 -0.31 0.00 0.31 0.00 0.00 61.69 63.13 3hbh s THR 139 Cb -0.34 -3.78 -0.13 0.00 0.01 0.00 0.00 72.50 68.26 3hbh s THR 139 CO 0.42 0.20 1.51 -0.24 -0.69 0.00 0.00 174.62 175.83 3hbh n SER 140 N 4.71 3.25 0.00 3.53 2.88 -1.26 -1.77 113.62 124.96 3hbh n SER 140 Ca -0.06 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.61 3hbh n SER 140 Cb 0.51 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 3hbh n SER 140 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hbh n GLY 141 N 2.45 1.33 3.84 0.46 0.00 -1.26 -5.05 105.19 106.97 3hbh n GLY 141 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3hbh n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hbh s LYS 142 N -0.53 3.14 -0.08 1.61 -0.14 -0.73 -5.10 119.74 117.91 3hbh s LYS 142 Ca 0.00 -0.57 0.02 0.00 -1.36 0.00 0.00 55.97 54.06 3hbh s LYS 142 Cb 0.00 -2.87 -0.02 0.00 -1.68 0.00 0.00 37.83 33.25 3hbh s LYS 142 CO 0.00 0.59 -0.14 0.45 -0.76 0.00 0.00 175.35 175.48 3hbh s SER 143 N -2.44 3.97 -0.45 2.83 0.15 -1.26 -4.88 113.70 111.61 3hbh s SER 143 Ca 0.32 -0.26 0.04 0.00 0.70 0.00 0.00 55.95 56.74 3hbh s SER 143 Cb -0.13 -1.14 0.50 0.00 -1.71 0.00 0.00 66.02 63.54 3hbh s SER 143 CO 0.25 0.27 1.67 -1.22 1.20 0.00 0.00 173.24 175.41 3hbh n TYR 144 N 2.81 2.55 -1.27 3.44 4.01 0.11 -4.82 117.16 123.99 3hbh n TYR 144 Ca -0.18 -2.30 -0.31 0.00 -0.16 0.00 0.00 57.90 54.96 3hbh n TYR 144 Cb 0.52 -0.87 0.10 0.00 -0.31 0.00 0.00 39.34 38.79 3hbh n TYR 144 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 3hbh s HIS 145 N -3.55 2.53 0.25 -0.72 -3.43 -1.26 -0.64 115.29 108.48 3hbh s HIS 145 Ca 0.55 1.44 -0.30 0.00 -0.80 0.00 0.00 55.06 55.95 3hbh s HIS 145 Cb 0.46 -3.08 -0.11 0.00 -1.43 0.00 0.00 32.58 28.42 3hbh s HIS 145 CO 0.02 -1.96 1.57 0.20 -2.00 0.00 0.00 174.74 172.57 3hbh s GLY 146 N -3.44 1.96 -0.02 -1.38 0.00 -1.24 -4.65 107.32 98.55 3hbh s GLY 146 Ca 0.62 1.48 -0.03 0.00 0.00 0.00 0.00 44.72 46.79 3hbh s GLY 146 CO 0.56 2.54 0.08 0.50 0.00 0.00 0.00 173.10 176.78 3hbh s ARG 147 N 0.01 0.20 0.14 2.90 0.52 -1.04 -0.71 118.95 120.96 3hbh s ARG 147 Ca 0.65 -0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.77 3hbh s ARG 147 Cb -0.46 0.08 0.00 0.00 0.52 0.00 0.00 34.95 35.10 3hbh s ARG 147 CO 0.42 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.11 3hbh n GLY 148 N 2.53 -2.71 0.34 -3.53 0.00 -0.60 -1.34 105.19 99.87 3hbh n GLY 148 Ca -0.16 -1.69 0.12 0.00 0.00 0.00 0.00 46.02 44.29 3hbh n GLY 148 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hbh h PRO 149 N 0.00 0.27 -0.06 1.61 0.11 -1.89 -1.49 132.00 130.56 3hbh h PRO 149 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3hbh h PRO 149 Cb 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.05 3hbh h PRO 149 CO 0.00 0.18 0.00 1.28 -0.21 0.00 0.00 178.00 179.25 3hbh n LEU 150 N -4.47 2.61 -3.63 2.35 4.77 -1.26 -4.27 117.00 113.10 3hbh n LEU 150 Ca 0.07 -2.93 -0.22 0.00 -0.03 0.00 0.00 56.01 52.90 3hbh n LEU 150 Cb 0.33 -0.40 0.04 0.00 -2.33 0.00 0.00 43.42 41.06 3hbh n LEU 150 CO 0.35 0.68 -0.05 0.00 -1.33 0.00 0.00 177.39 177.04 3hbh n GLN 151 N -1.11 -4.05 -1.66 3.23 1.13 -0.56 -4.86 117.38 109.50 3hbh n GLN 151 Ca 0.15 0.63 -0.57 0.00 -1.94 0.00 0.00 57.00 55.27 3hbh n GLN 151 Cb 0.64 -5.12 -0.07 0.00 0.11 0.00 0.00 30.24 25.80 3hbh n GLN 151 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 3hbh n LEU 152 N -4.12 1.85 -4.05 1.08 7.94 -0.45 -4.30 117.00 114.96 3hbh n LEU 152 Ca -0.24 1.11 -0.14 0.00 -1.11 0.00 0.00 56.01 55.63 3hbh n LEU 152 Cb 0.66 -1.11 -0.12 0.00 0.53 0.00 0.00 43.42 43.37 3hbh n LEU 152 CO 0.67 -0.78 -0.41 -0.44 -1.11 0.00 0.00 177.39 175.32 3hbh s SER 153 N 2.26 0.85 0.00 1.96 0.01 -1.26 -2.51 113.70 115.01 3hbh s SER 153 Ca 0.94 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.75 3hbh s SER 153 Cb -1.09 0.01 0.00 0.00 0.21 0.00 0.00 66.02 65.14 3hbh s SER 153 CO 0.61 -0.14 0.00 0.79 0.41 0.00 0.00 173.24 174.91 3hbh n TRP 154 N 1.79 0.00 -0.24 2.43 7.02 0.19 -4.42 117.44 124.21 3hbh n TRP 154 Ca -0.20 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.32 3hbh n TRP 154 Cb 0.55 -0.86 0.16 0.00 -2.42 0.00 0.00 31.31 28.75 3hbh n TRP 154 CO 0.00 0.00 0.00 -2.95 -2.02 0.00 0.00 177.69 172.72 3hbh h ASN 155 N 0.00 -0.09 -0.70 -0.99 -1.07 -1.75 -1.58 115.58 109.40 3hbh h ASN 155 Ca 0.00 0.15 0.06 0.00 0.07 0.00 0.00 56.30 56.58 3hbh h ASN 155 Cb 0.00 0.23 -0.04 0.00 -2.07 0.00 0.00 38.32 36.44 3hbh h ASN 155 CO 0.00 -0.07 0.46 0.10 0.07 0.00 0.00 177.43 177.99 3hbh h TYR 156 N 0.21 0.74 0.09 4.14 -0.00 -1.88 0.13 116.97 120.40 3hbh h TYR 156 Ca 0.40 0.02 -0.26 0.00 0.00 0.00 0.00 58.73 58.89 3hbh h TYR 156 Cb 0.68 -0.25 0.03 0.00 0.00 0.00 0.00 36.73 37.19 3hbh h TYR 156 CO -0.30 0.40 -1.07 -0.91 -0.00 0.00 0.00 178.16 176.28 3hbh h ASN 157 N 0.74 0.79 -0.60 0.10 -0.26 -1.54 -2.66 115.58 112.16 3hbh h ASN 157 Ca 0.30 -0.81 -0.06 0.00 -0.56 0.00 0.00 56.30 55.16 3hbh h ASN 157 Cb 0.23 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.21 3hbh h ASN 157 CO -0.10 1.52 0.14 1.88 -1.06 0.00 0.00 177.43 179.82 3hbh h TYR 158 N 0.16 1.04 0.56 1.19 -1.99 -0.95 0.21 116.97 117.18 3hbh h TYR 158 Ca -0.16 -0.12 -0.02 0.00 2.00 0.00 0.00 58.73 60.43 3hbh h TYR 158 Cb 1.76 -0.30 0.00 0.00 2.00 0.00 0.00 36.73 40.20 3hbh h TYR 158 CO 0.13 0.86 -0.30 0.78 -0.00 0.00 0.00 178.16 179.62 3hbh h GLY 159 N 1.04 -0.84 1.00 3.88 0.00 -0.82 0.10 103.07 107.44 3hbh h GLY 159 Ca 0.20 0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.86 3hbh h GLY 159 CO 0.00 -0.31 0.42 0.00 0.00 0.00 0.00 176.54 176.66 3hbh h ALA 160 N -0.38 0.88 -0.16 3.60 0.00 -1.29 -2.14 119.26 119.76 3hbh h ALA 160 Ca -0.07 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.78 3hbh h ALA 160 Cb 0.63 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3hbh h ALA 160 CO 0.10 0.35 0.05 0.00 0.00 0.00 0.00 179.25 179.74 3hbh h ALA 161 N 1.22 0.17 -0.99 0.00 0.00 -0.51 -2.11 119.26 117.05 3hbh h ALA 161 Ca 0.25 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.20 3hbh h ALA 161 Cb -0.04 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 3hbh h ALA 161 CO -0.05 -0.39 0.65 0.78 0.00 0.00 0.00 179.25 180.24 3hbh h GLY 162 N 0.12 1.40 1.01 0.00 0.00 -0.50 -1.23 103.07 103.87 3hbh h GLY 162 Ca 0.07 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 3hbh h GLY 162 CO -0.08 0.48 0.29 1.70 0.00 0.00 0.00 176.54 178.94 3hbh h LYS 163 N 1.31 0.97 -0.53 4.80 3.64 -1.20 0.13 116.57 125.69 3hbh h LYS 163 Ca 0.37 -0.16 -0.09 0.00 -1.27 0.00 0.00 60.65 59.50 3hbh h LYS 163 Cb -0.11 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.52 3hbh h LYS 163 CO -0.09 0.79 -0.02 1.03 -2.27 0.00 0.00 179.45 178.89 3hbh h SER 164 N 0.92 0.94 0.30 4.20 0.87 -0.72 -3.36 113.55 116.69 3hbh h SER 164 Ca 0.22 -0.31 -0.33 0.00 -1.23 0.00 0.00 61.79 60.14 3hbh h SER 164 Cb 0.16 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 61.83 3hbh h SER 164 CO -0.02 1.02 -1.89 -0.38 -0.53 0.00 0.00 176.83 175.03 3hbh n ILE 165 N -4.26 1.67 0.00 2.23 5.41 -0.53 -5.01 119.36 118.87 3hbh n ILE 165 Ca 0.01 -0.73 0.00 0.00 1.00 0.00 0.00 62.75 63.03 3hbh n ILE 165 Cb 0.34 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.94 3hbh n ILE 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hbh n GLY 166 N 1.78 1.44 3.17 7.39 0.00 0.38 -5.08 105.19 114.27 3hbh n GLY 166 Ca -0.25 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 3hbh n GLY 166 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hbh s PHE 167 N -2.00 0.63 -0.83 1.61 -0.12 -0.71 -5.05 117.98 111.51 3hbh s PHE 167 Ca 0.00 -1.05 -0.24 0.00 -0.05 0.00 0.00 56.93 55.59 3hbh s PHE 167 Cb 0.00 -0.35 0.05 0.00 -0.63 0.00 0.00 43.02 42.10 3hbh s PHE 167 CO 0.00 -0.52 1.26 0.34 -0.05 0.00 0.00 175.22 176.25 3hbh s ASP 168 N -2.98 6.31 0.32 1.98 -1.08 -1.26 -4.04 116.67 115.91 3hbh s ASP 168 Ca 0.17 -1.01 0.02 0.00 -0.52 0.00 0.00 52.55 51.21 3hbh s ASP 168 Cb 0.07 -2.52 0.54 0.00 -1.46 0.00 0.00 42.92 39.54 3hbh s ASP 168 CO -0.03 -1.59 1.86 1.23 0.52 0.00 0.00 175.17 177.16 3hbh h GLY 169 N 12.41 0.68 1.22 2.66 0.00 -1.84 0.14 103.07 118.34 3hbh h GLY 169 Ca -0.09 -0.39 -0.24 0.00 0.00 0.00 0.00 47.33 46.60 3hbh h GLY 169 CO 1.29 0.37 -0.91 1.41 0.00 0.00 0.00 176.54 178.70 3hbh h LEU 170 N 0.61 0.90 0.00 3.11 3.38 -1.89 -3.06 115.31 118.37 3hbh h LEU 170 Ca 0.13 -0.66 -0.10 0.00 0.09 0.00 0.00 57.88 57.34 3hbh h LEU 170 Cb 0.30 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3hbh h LEU 170 CO 0.00 1.46 -1.92 0.59 0.09 0.00 0.00 178.44 178.66 3hbh n ASN 171 N -3.89 0.18 -2.83 -0.43 3.02 -1.15 -4.34 115.26 105.82 3hbh n ASN 171 Ca -0.09 0.08 -0.19 0.00 -0.03 0.00 0.00 54.58 54.35 3hbh n ASN 171 Cb 0.81 1.41 -0.01 0.00 -0.61 0.00 0.00 39.78 41.39 3hbh n ASN 171 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3hbh n ASN 172 N -2.48 2.50 0.28 6.41 3.02 0.47 -4.90 115.26 120.56 3hbh n ASN 172 Ca -0.11 -3.19 0.13 0.00 -0.03 0.00 0.00 54.58 51.38 3hbh n ASN 172 Cb 0.73 -0.55 0.81 0.00 -0.61 0.00 0.00 39.78 40.17 3hbh n ASN 172 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3hbh h PRO 173 N 2.91 0.00 0.00 3.52 0.13 -1.68 -2.21 132.00 134.67 3hbh h PRO 173 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3hbh h PRO 173 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 3hbh h PRO 173 CO 0.63 0.04 0.00 1.05 -0.23 0.00 0.00 178.00 179.49 3hbh h GLU 174 N 0.00 0.00 -0.36 0.86 9.09 -1.89 -2.52 114.58 119.76 3hbh h GLU 174 Ca -0.00 0.00 0.11 0.00 0.05 0.00 0.00 59.36 59.52 3hbh h GLU 174 Cb 0.09 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.17 3hbh h GLU 174 CO 0.00 0.00 0.28 0.87 0.05 0.00 0.00 179.01 180.22 3hbh h LYS 175 N 0.00 0.00 0.00 1.06 1.57 -1.79 0.33 116.57 117.74 3hbh h LYS 175 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3hbh h LYS 175 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3hbh h LYS 175 CO 0.00 0.00 -0.17 0.28 -0.57 0.00 0.00 179.45 178.99 3hbh h VAL 176 N 0.00 0.58 -0.01 0.50 2.07 -1.67 -1.35 116.25 116.36 3hbh h VAL 176 Ca 0.17 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3hbh h VAL 176 Cb 0.74 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3hbh h VAL 176 CO -0.00 0.17 -0.37 0.61 0.02 0.00 0.00 177.57 178.00 3hbh n GLY 177 N -0.37 -0.26 0.01 2.17 0.00 0.11 -4.27 105.19 102.58 3hbh n GLY 177 Ca -0.01 -0.53 -0.01 0.00 0.00 0.00 0.00 46.02 45.47 3hbh n GLY 177 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hbh n GLN 178 N -0.31 3.52 -3.91 1.61 6.02 -0.78 -4.96 117.38 118.57 3hbh n GLN 178 Ca 0.11 -0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.75 3hbh n GLN 178 Cb 0.41 -1.06 -0.14 0.00 1.02 0.00 0.00 30.24 30.47 3hbh n GLN 178 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3hbh s ASP 179 N -3.26 4.67 0.20 1.08 -1.08 -0.54 -5.02 116.67 112.71 3hbh s ASP 179 Ca -0.01 -1.02 -0.13 0.00 -0.52 0.00 0.00 52.55 50.86 3hbh s ASP 179 Cb 0.01 -1.71 0.21 0.00 -1.46 0.00 0.00 42.92 39.97 3hbh s ASP 179 CO 0.10 -0.19 1.66 0.28 0.52 0.00 0.00 175.17 177.53 3hbh h SER 180 N 8.04 -0.36 -0.33 -0.34 0.02 -1.86 0.33 113.55 119.06 3hbh h SER 180 Ca -0.28 0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 60.75 3hbh h SER 180 Cb 1.09 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.90 3hbh h SER 180 CO 0.56 -0.13 -0.08 0.74 -1.14 0.00 0.00 176.83 176.78 3hbh h THR 181 N 0.06 1.28 -0.09 -2.27 2.02 -1.92 -1.38 112.91 110.61 3hbh h THR 181 Ca 0.27 -1.13 0.01 0.00 0.77 0.00 0.00 66.41 66.33 3hbh h THR 181 Cb 0.43 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 3hbh h THR 181 CO -0.51 0.37 0.03 0.40 0.37 0.00 0.00 175.52 176.18 3hbh h ILE 182 N 0.41 0.98 -0.28 3.11 2.04 -1.78 -0.21 117.51 121.78 3hbh h ILE 182 Ca 0.08 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.97 3hbh h ILE 182 Cb 0.57 0.90 -0.08 0.00 -0.74 0.00 0.00 36.82 37.48 3hbh h ILE 182 CO 0.03 0.01 -0.47 -1.28 0.00 0.00 0.00 178.15 176.44 3hbh h SER 183 N 0.08 -1.53 -0.74 1.72 0.87 -0.22 -1.39 113.55 112.33 3hbh h SER 183 Ca 0.04 0.21 0.03 0.00 -1.23 0.00 0.00 61.79 60.84 3hbh h SER 183 Cb 0.02 0.64 -0.05 0.00 -0.44 0.00 0.00 62.40 62.57 3hbh h SER 183 CO -0.04 -0.41 0.47 -0.26 -0.53 0.00 0.00 176.83 176.06 3hbh h PHE 184 N -0.43 0.88 -0.97 2.24 0.04 -1.13 -2.79 116.94 114.78 3hbh h PHE 184 Ca 0.09 0.02 0.13 0.00 2.80 0.00 0.00 57.97 61.02 3hbh h PHE 184 Cb 0.62 -0.29 -0.08 0.00 2.20 0.00 0.00 35.95 38.40 3hbh h PHE 184 CO -0.60 0.50 0.61 0.87 -0.60 0.00 0.00 178.31 179.09 3hbh h LYS 185 N 0.91 0.86 -0.65 1.51 1.57 -0.60 -1.73 116.57 118.44 3hbh h LYS 185 Ca 0.30 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 59.07 3hbh h LYS 185 Cb 0.02 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 3hbh h LYS 185 CO -0.11 0.57 0.43 1.79 -0.57 0.00 0.00 179.45 181.56 3hbh h THR 186 N 0.89 1.08 0.01 -0.16 1.35 -0.98 0.25 112.91 115.34 3hbh h THR 186 Ca 0.49 -0.26 -0.06 0.00 -0.55 0.00 0.00 66.41 66.03 3hbh h THR 186 Cb 0.58 0.25 0.01 0.00 -1.73 0.00 0.00 68.15 67.26 3hbh h THR 186 CO -0.25 0.14 -0.25 0.00 -0.25 0.00 0.00 175.52 174.91 3hbh h ALA 187 N 1.62 0.01 -0.62 6.62 0.00 -1.32 -1.09 119.26 124.48 3hbh h ALA 187 Ca 0.26 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3hbh h ALA 187 Cb 0.10 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3hbh h ALA 187 CO -0.07 0.08 0.32 0.28 0.00 0.00 0.00 179.25 179.86 3hbh h VAL 188 N -0.59 1.20 -0.38 0.00 2.07 -1.22 -1.58 116.25 115.75 3hbh h VAL 188 Ca -0.03 -0.54 0.06 0.00 0.82 0.00 0.00 66.70 67.01 3hbh h VAL 188 Cb 1.05 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 3hbh h VAL 188 CO 0.05 0.23 0.05 -0.25 0.02 0.00 0.00 177.57 177.67 3hbh h TRP 189 N 0.84 0.08 -0.23 1.57 7.01 -0.55 0.11 115.95 124.77 3hbh h TRP 189 Ca 0.22 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.24 3hbh h TRP 189 Cb 0.07 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.14 3hbh h TRP 189 CO -0.01 -0.01 0.13 0.35 -2.79 0.00 0.00 178.44 176.11 3hbh h PHE 190 N 0.17 0.32 -0.52 2.65 3.04 -0.90 0.11 116.94 121.81 3hbh h PHE 190 Ca 0.19 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.22 3hbh h PHE 190 Cb 0.23 -0.10 -0.08 0.00 2.56 0.00 0.00 35.95 38.56 3hbh h PHE 190 CO -0.22 0.28 0.08 2.35 -2.02 0.00 0.00 178.31 178.79 3hbh h TRP 191 N 0.26 0.12 0.07 0.41 2.91 -1.10 -1.17 115.95 117.45 3hbh h TRP 191 Ca 0.08 0.03 -0.33 0.00 1.13 0.00 0.00 58.89 59.80 3hbh h TRP 191 Cb 0.07 0.02 -0.03 0.00 -0.51 0.00 0.00 29.16 28.71 3hbh h TRP 191 CO -0.03 -0.04 -1.86 -1.33 -1.03 0.00 0.00 178.44 174.14 3hbh n MET 192 N -5.15 0.70 0.00 2.65 2.81 0.36 -2.43 117.12 116.07 3hbh n MET 192 Ca 0.06 0.28 0.00 0.00 -1.81 0.00 0.00 57.70 56.23 3hbh n MET 192 Cb 0.27 -1.75 0.00 0.00 -0.71 0.00 0.00 33.22 31.03 3hbh n MET 192 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3hbh n LYS 193 N -3.27 3.76 -0.13 0.03 4.76 0.37 -4.82 118.16 118.86 3hbh n LYS 193 Ca -0.25 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.24 3hbh n LYS 193 Cb 1.05 -0.69 0.07 0.00 -1.84 0.00 0.00 35.03 33.62 3hbh n LYS 193 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3hbh n ASN 194 N -1.13 1.59 -3.59 4.39 4.05 -0.51 -4.99 115.26 115.07 3hbh n ASN 194 Ca 0.00 -2.43 -0.06 0.00 0.45 0.00 0.00 54.58 52.54 3hbh n ASN 194 Cb 0.00 -0.25 -0.01 0.00 1.23 0.00 0.00 39.78 40.76 3hbh n ASN 194 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 3hbh s SER 195 N -1.81 -0.16 -0.07 1.20 1.04 -0.82 -4.93 113.70 108.15 3hbh s SER 195 Ca 0.15 -0.68 0.07 0.00 0.48 0.00 0.00 55.95 55.98 3hbh s SER 195 Cb 0.14 0.67 0.33 0.00 0.10 0.00 0.00 66.02 67.26 3hbh s SER 195 CO 0.01 -1.27 1.09 0.59 0.98 0.00 0.00 173.24 174.64 3hbh n ASN 196 N -0.74 2.67 0.16 7.02 5.03 -1.26 -4.57 115.26 123.57 3hbh n ASN 196 Ca -0.05 -2.29 -0.14 0.00 0.87 0.00 0.00 54.58 52.96 3hbh n ASN 196 Cb 0.60 -0.48 -0.08 0.00 -1.02 0.00 0.00 39.78 38.79 3hbh n ASN 196 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3hbh h HIS 198 N -0.55 -0.19 -0.50 0.00 -0.00 -1.72 -2.41 115.15 109.77 3hbh h HIS 198 Ca -0.04 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.35 3hbh h HIS 198 Cb 0.40 0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 27.88 3hbh h HIS 198 CO -0.01 -0.12 0.33 0.66 -0.00 0.00 0.00 177.93 178.78 3hbh h SER 199 N -0.12 0.56 -0.14 3.26 4.64 -1.85 -1.87 113.55 118.03 3hbh h SER 199 Ca 0.04 -0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.39 3hbh h SER 199 Cb 0.18 -0.14 -0.04 0.00 -0.31 0.00 0.00 62.40 62.09 3hbh h SER 199 CO -0.10 0.40 -0.11 0.00 -0.87 0.00 0.00 176.83 176.15 3hbh h ALA 200 N 1.19 -0.00 0.00 5.18 0.00 -0.61 -2.28 119.26 122.74 3hbh h ALA 200 Ca 0.19 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hbh h ALA 200 Cb -0.06 0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3hbh h ALA 200 CO -0.05 -0.56 0.00 0.97 0.00 0.00 0.00 179.25 179.61 3hbh h ILE 201 N -0.12 0.00 -0.54 0.00 6.09 -1.25 -2.40 117.51 119.28 3hbh h ILE 201 Ca 0.09 -0.54 0.00 0.00 -1.37 0.00 0.00 64.86 63.04 3hbh h ILE 201 Cb 0.26 1.47 0.00 0.00 0.47 0.00 0.00 36.82 39.02 3hbh h ILE 201 CO -0.22 0.00 0.00 0.35 -3.07 0.00 0.00 178.15 175.21 3hbh n THR 202 N -2.73 1.66 -2.35 2.19 -2.24 -0.72 -4.44 114.28 105.65 3hbh n THR 202 Ca 0.03 -1.24 0.04 0.00 -2.27 0.00 0.00 64.05 60.61 3hbh n THR 202 Cb 0.36 0.18 0.06 0.00 -2.10 0.00 0.00 70.33 68.83 3hbh n THR 202 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hbh n SER 203 N 0.82 1.20 0.00 3.42 3.41 -0.87 -5.02 113.62 116.58 3hbh n SER 203 Ca 0.22 -2.36 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 3hbh n SER 203 Cb 0.77 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3hbh n SER 203 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hbh n GLY 204 N 0.14 0.59 0.01 5.00 0.00 -1.22 -4.91 105.19 104.80 3hbh n GLY 204 Ca 0.09 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.26 3hbh n GLY 204 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hbh n GLN 205 N -2.30 0.41 0.00 1.61 6.02 -0.93 -4.86 117.38 117.34 3hbh n GLN 205 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 3hbh n GLN 205 Cb 0.04 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.80 3hbh n GLN 205 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hbh n GLY 206 N 1.30 -0.63 0.35 1.08 0.00 -1.24 -1.94 105.19 104.11 3hbh n GLY 206 Ca 0.14 -0.99 -0.05 0.00 0.00 0.00 0.00 46.02 45.12 3hbh n GLY 206 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3hbh h PHE 207 N 0.00 1.22 -0.27 1.61 3.57 -1.76 -1.62 116.94 119.70 3hbh h PHE 207 Ca 0.00 -0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.46 3hbh h PHE 207 Cb 0.00 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.35 3hbh h PHE 207 CO 0.00 0.90 0.18 0.78 -2.23 0.00 0.00 178.31 177.94 3hbh h GLY 208 N 1.20 0.25 1.85 2.40 0.00 -0.45 -1.02 103.07 107.30 3hbh h GLY 208 Ca 0.28 -0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.40 3hbh h GLY 208 CO -0.03 0.07 -0.55 -1.33 0.00 0.00 0.00 176.54 174.70 3hbh h GLY 209 N 0.22 0.17 1.26 4.60 0.00 -0.61 -1.98 103.07 106.72 3hbh h GLY 209 Ca 0.11 -0.20 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 3hbh h GLY 209 CO -0.02 0.18 -0.40 -0.91 0.00 0.00 0.00 176.54 175.39 3hbh h THR 210 N 0.12 1.28 -0.26 4.70 1.35 -1.03 -2.34 112.91 116.73 3hbh h THR 210 Ca -0.00 -1.58 0.04 0.00 -0.55 0.00 0.00 66.41 64.33 3hbh h THR 210 Cb 1.01 1.45 -0.04 0.00 -1.73 0.00 0.00 68.15 68.84 3hbh h THR 210 CO 0.08 0.52 0.01 0.40 -0.25 0.00 0.00 175.52 176.27 3hbh h ILE 211 N 0.66 0.82 -0.38 6.82 2.04 -1.11 -1.65 117.51 124.72 3hbh h ILE 211 Ca 0.05 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 3hbh h ILE 211 Cb 0.96 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 3hbh h ILE 211 CO 0.09 0.02 0.15 0.50 0.00 0.00 0.00 178.15 178.91 3hbh h LYS 212 N 0.09 0.53 -0.10 2.37 3.64 -1.36 -0.30 116.57 121.44 3hbh h LYS 212 Ca 0.12 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 3hbh h LYS 212 Cb 0.16 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3hbh h LYS 212 CO -0.20 0.44 -0.31 0.00 -2.27 0.00 0.00 179.45 177.11 3hbh h ALA 213 N 1.64 1.31 0.03 5.00 0.00 -0.97 -3.17 119.26 123.10 3hbh h ALA 213 Ca 0.13 -0.33 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 3hbh h ALA 213 Cb 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hbh h ALA 213 CO -0.01 0.48 -1.05 0.82 0.00 0.00 0.00 179.25 179.49 3hbh h ILE 214 N 0.16 1.13 -1.17 0.00 2.04 -0.34 -3.42 117.51 115.91 3hbh h ILE 214 Ca 0.02 -2.28 -0.19 0.00 1.00 0.00 0.00 64.86 63.41 3hbh h ILE 214 Cb 0.63 2.61 -0.19 0.00 -0.74 0.00 0.00 36.82 39.13 3hbh h ILE 214 CO 0.05 0.50 -0.54 0.21 0.00 0.00 0.00 178.15 178.36 3hbh s ASN 215 N -6.77 -1.08 0.43 1.72 2.47 -0.22 -5.02 114.94 106.47 3hbh s ASN 215 Ca -0.24 -1.77 0.30 0.00 0.42 0.00 0.00 52.86 51.57 3hbh s ASN 215 Cb 0.04 1.62 1.46 0.00 -1.45 0.00 0.00 41.25 42.91 3hbh s ASN 215 CO 0.66 -0.08 1.90 0.77 -3.72 0.00 0.00 177.10 176.63 3hbh h SER 216 N 5.36 0.00 0.13 -4.21 4.64 -1.70 -2.34 113.55 115.43 3hbh h SER 216 Ca 0.08 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 3hbh h SER 216 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3hbh h SER 216 CO 0.06 0.00 -0.06 -0.03 -0.87 0.00 0.00 176.83 175.93 3hbh h MET 217 N 0.00 0.00 -0.08 4.77 -1.53 -1.93 -2.58 114.93 113.58 3hbh h MET 217 Ca 0.00 0.00 -0.11 0.00 -3.44 0.00 0.00 59.70 56.15 3hbh h MET 217 Cb 0.19 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.23 3hbh h MET 217 CO 0.00 0.06 -0.46 0.93 0.14 0.00 0.00 176.91 177.58 3hbh h GLU 218 N 0.00 0.20 -7.51 0.39 5.08 -1.75 -3.34 114.58 107.65 3hbh h GLU 218 Ca -0.00 -0.10 -0.46 0.00 -1.00 0.00 0.00 59.36 57.79 3hbh h GLU 218 Cb 0.14 0.00 0.12 0.00 0.50 0.00 0.00 28.75 29.52 3hbh h GLU 218 CO 0.01 0.62 0.32 0.00 -1.00 0.00 0.00 179.01 178.96 3hbh n ASN 220 N -3.68 -2.87 -0.74 0.00 3.02 -0.41 -1.69 115.26 108.89 3hbh n ASN 220 Ca 0.07 -0.84 -0.10 0.00 -0.03 0.00 0.00 54.58 53.68 3hbh n ASN 220 Cb 0.59 -3.73 -0.04 0.00 -0.61 0.00 0.00 39.78 36.00 3hbh n ASN 220 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hbh n GLY 221 N -1.67 1.00 0.35 7.41 0.00 -1.26 -4.90 105.19 106.12 3hbh n GLY 221 Ca -0.11 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 3hbh n GLY 221 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hbh h GLY 222 N 0.00 -0.65 -6.41 -0.02 0.00 -1.17 -3.41 103.07 91.41 3hbh h GLY 222 Ca -0.20 0.40 -0.28 0.00 0.00 0.00 0.00 47.33 47.25 3hbh h GLY 222 CO 0.29 -0.25 -0.60 0.21 0.00 0.00 0.00 176.54 176.18 3hbh s ASN 223 N -4.75 1.11 0.37 0.19 3.84 0.04 -4.88 114.94 110.86 3hbh s ASN 223 Ca -0.16 -0.73 0.20 0.00 0.21 0.00 0.00 52.86 52.38 3hbh s ASN 223 Cb 0.08 0.75 0.50 0.00 -0.55 0.00 0.00 41.25 42.02 3hbh s ASN 223 CO 0.64 -0.36 1.64 0.77 -2.79 0.00 0.00 177.10 177.01 3hbh h SER 224 N 8.06 0.00 -0.37 -4.21 4.64 -1.80 -2.62 113.55 117.25 3hbh h SER 224 Ca -0.09 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 3hbh h SER 224 Cb 1.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.16 3hbh h SER 224 CO 0.29 0.32 0.20 1.23 -0.87 0.00 0.00 176.83 178.00 3hbh h GLY 225 N 2.87 0.55 0.88 -0.77 0.00 -1.96 -0.80 103.07 103.84 3hbh h GLY 225 Ca -0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 3hbh h GLY 225 CO 0.04 0.24 0.03 0.83 0.00 0.00 0.00 176.54 177.68 3hbh h GLU 226 N 0.47 0.48 -0.42 4.80 5.08 -1.92 -1.21 114.58 121.85 3hbh h GLU 226 Ca 0.13 -0.14 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 3hbh h GLU 226 Cb 0.05 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 3hbh h GLU 226 CO -0.02 0.61 -0.10 0.28 -1.00 0.00 0.00 179.01 178.78 3hbh h VAL 227 N 0.29 0.58 -0.21 3.13 2.07 -1.44 -1.96 116.25 118.71 3hbh h VAL 227 Ca 0.08 -0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.50 3hbh h VAL 227 Cb 0.38 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3hbh h VAL 227 CO 0.01 0.00 -0.32 0.28 0.02 0.00 0.00 177.57 177.56 3hbh h SER 228 N 0.00 0.44 0.02 0.57 0.02 -0.88 -0.13 113.55 113.59 3hbh h SER 228 Ca 0.20 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3hbh h SER 228 Cb 0.31 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.73 3hbh h SER 228 CO -0.43 0.74 -0.01 -1.28 -1.14 0.00 0.00 176.83 174.71 3hbh h SER 229 N 0.37 -0.02 -0.21 3.07 0.87 -1.08 0.41 113.55 116.96 3hbh h SER 229 Ca 0.05 -0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 3hbh h SER 229 Cb 0.74 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.70 3hbh h SER 229 CO 0.06 0.04 -0.02 0.03 -0.53 0.00 0.00 176.83 176.41 3hbh h ARG 230 N -0.08 0.38 -0.57 2.24 3.08 -0.97 -2.80 114.38 115.67 3hbh h ARG 230 Ca -0.00 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 59.93 3hbh h ARG 230 Cb 0.07 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 3hbh h ARG 230 CO 0.00 0.60 0.36 0.28 -1.07 0.00 0.00 179.97 180.14 3hbh h VAL 231 N 0.13 1.11 -0.29 2.04 2.07 -0.98 -1.28 116.25 119.06 3hbh h VAL 231 Ca 0.06 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.38 3hbh h VAL 231 Cb 0.43 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 3hbh h VAL 231 CO 0.01 0.13 -0.07 -1.13 0.02 0.00 0.00 177.57 176.54 3hbh h ASN 232 N 0.73 -0.26 -0.58 0.57 -0.73 -0.17 -0.70 115.58 114.45 3hbh h ASN 232 Ca 0.22 0.09 0.04 0.00 1.87 0.00 0.00 56.30 58.51 3hbh h ASN 232 Cb -0.04 0.18 -0.04 0.00 0.27 0.00 0.00 38.32 38.68 3hbh h ASN 232 CO -0.07 -0.09 0.33 1.88 -0.37 0.00 0.00 177.43 179.11 3hbh h TYR 233 N 0.00 0.60 -0.22 0.67 0.99 -1.20 -1.91 116.97 115.90 3hbh h TYR 233 Ca 0.14 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.91 3hbh h TYR 233 Cb 0.21 -0.19 -0.02 0.00 1.00 0.00 0.00 36.73 37.73 3hbh h TYR 233 CO -0.28 0.31 0.08 -0.92 -0.00 0.00 0.00 178.16 177.36 3hbh h TYR 234 N 0.63 0.15 -0.48 4.88 3.20 -0.82 -0.42 116.97 124.11 3hbh h TYR 234 Ca 0.25 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.13 3hbh h TYR 234 Cb 0.10 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 3hbh h TYR 234 CO -0.08 0.07 0.32 0.87 -1.64 0.00 0.00 178.16 177.70 3hbh h LYS 235 N 0.19 0.62 -0.64 1.82 1.57 -1.00 0.14 116.57 119.26 3hbh h LYS 235 Ca 0.09 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 3hbh h LYS 235 Cb 0.06 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 3hbh h LYS 235 CO -0.09 0.41 0.14 -0.22 -0.57 0.00 0.00 179.45 179.12 3hbh h LYS 236 N 0.64 1.03 -0.21 3.15 3.64 -1.20 -1.79 116.57 121.83 3hbh h LYS 236 Ca 0.18 -0.24 -0.14 0.00 -1.27 0.00 0.00 60.65 59.18 3hbh h LYS 236 Cb -0.07 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 3hbh h LYS 236 CO -0.04 0.92 -0.41 0.82 -2.27 0.00 0.00 179.45 178.47 3hbh h ILE 237 N 0.98 1.32 -0.23 2.00 2.04 -0.77 -2.28 117.51 120.56 3hbh h ILE 237 Ca 0.20 -1.63 0.06 0.00 1.00 0.00 0.00 64.86 64.49 3hbh h ILE 237 Cb 0.37 1.84 -0.07 0.00 -0.74 0.00 0.00 36.82 38.21 3hbh h ILE 237 CO 0.00 0.51 -0.35 0.00 0.00 0.00 0.00 178.15 178.31 3hbh h SER 239 N -0.37 0.27 0.32 0.00 4.64 -1.32 -0.23 113.55 116.86 3hbh h SER 239 Ca 0.12 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.34 3hbh h SER 239 Cb 0.56 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3hbh h SER 239 CO -0.43 0.34 -0.27 1.56 -0.87 0.00 0.00 176.83 177.16 3hbh h GLN 240 N 0.29 0.00 0.00 4.77 4.20 -1.07 -3.03 115.11 120.27 3hbh h GLN 240 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 3hbh h GLN 240 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 3hbh h GLN 240 CO 0.01 0.27 -0.39 1.28 -0.67 0.00 0.00 178.83 179.33 3hbh n LEU 241 N -4.09 0.41 -2.58 1.46 4.77 -0.20 -4.95 117.00 111.82 3hbh n LEU 241 Ca -0.02 0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 56.01 3hbh n LEU 241 Cb 0.33 -0.30 0.06 0.00 -2.33 0.00 0.00 43.42 41.18 3hbh n LEU 241 CO 0.37 0.07 0.07 0.61 -1.33 0.00 0.00 177.39 177.18 3hbh n GLY 242 N 1.48 -0.08 2.97 -0.72 0.00 -0.57 -5.06 105.19 103.20 3hbh n GLY 242 Ca 0.06 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 3hbh n GLY 242 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hbh s VAL 243 N -3.23 0.59 0.27 1.61 0.11 -0.63 -5.02 120.40 114.10 3hbh s VAL 243 Ca 0.01 -0.26 -0.31 0.00 -2.93 0.00 0.00 61.98 58.49 3hbh s VAL 243 Cb -0.01 -0.54 -0.12 0.00 -1.53 0.00 0.00 36.38 34.19 3hbh s VAL 243 CO 0.48 0.19 1.58 -0.67 -3.33 0.00 0.00 175.10 173.35 3hbh n ASP 244 N 3.29 3.69 0.31 3.54 2.03 -1.26 -4.13 116.55 124.01 3hbh n ASP 244 Ca -0.18 1.13 0.20 0.00 0.52 0.00 0.00 54.79 56.47 3hbh n ASP 244 Cb 0.55 -1.56 0.99 0.00 -0.72 0.00 0.00 41.12 40.38 3hbh n ASP 244 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3hbh h PRO 245 N 4.97 0.00 0.00 -0.67 0.11 -1.95 -3.48 132.00 130.98 3hbh h PRO 245 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hbh h PRO 245 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3hbh h PRO 245 CO 0.81 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.01 3hbh n GLY 246 N -0.61 -2.19 3.95 -0.55 0.00 -1.26 -4.81 105.19 99.72 3hbh n GLY 246 Ca -0.01 -1.50 -0.25 0.00 0.00 0.00 0.00 46.02 44.26 3hbh n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbh s ALA 247 N -1.03 3.33 -1.48 4.61 0.00 -1.26 -4.45 121.76 121.47 3hbh s ALA 247 Ca 0.00 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 50.74 3hbh s ALA 247 Cb 0.00 -2.40 0.02 0.00 0.00 0.00 0.00 23.12 20.74 3hbh s ALA 247 CO 0.00 -1.31 0.40 0.09 0.00 0.00 0.00 175.76 174.94 3hbh n ASN 248 N -2.86 -5.34 -0.06 0.00 3.02 -1.26 -4.38 115.26 104.38 3hbh n ASN 248 Ca 0.10 -0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 3hbh n ASN 248 Cb 0.60 -4.37 0.30 0.00 -0.61 0.00 0.00 39.78 35.70 3hbh n ASN 248 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3hbh h VAL 249 N -0.88 1.18 -0.74 2.41 2.07 -1.88 0.26 116.25 118.67 3hbh h VAL 249 Ca -0.48 -0.57 -0.64 0.00 0.82 0.00 0.00 66.70 65.84 3hbh h VAL 249 Cb 1.33 0.63 -0.11 0.00 -1.52 0.00 0.00 31.29 31.62 3hbh h VAL 249 CO 0.54 0.22 -0.48 -0.55 0.02 0.00 0.00 177.57 177.32 3hbh s SER 250 N -6.63 4.24 0.00 0.57 0.15 -1.26 -2.20 113.70 108.57 3hbh s SER 250 Ca -0.09 -1.46 0.00 0.00 0.70 0.00 0.00 55.95 55.10 3hbh s SER 250 Cb 0.16 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 3hbh s SER 250 CO 0.77 -0.81 0.00 0.00 1.20 0.00 0.00 173.24 174.40